1,2,3,4,5,6-hexakis(hexylsulfanyl)triphenylene

Systemtic Name: 1,2,3,4,5,6-hexakis(hexylsulfanyl)triphenylene Openeye Name: 1,2,3,4,5,6-hexakis(hexylsulfanyl)triphenylene CAS Name: 1,2,3,4,5,6-hexakis(hexylthio)triphenylene IUPAC Name: 1,2,3,4,5,6-hexakis(hexylsulfanyl)triphenylene Traditional Name: 1,2,3,4,5,6-hexakis(hexylthio)triphenylene Formula: C54H84S6 MolecularWeight: 925.63476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=C(C2=C(C=C1)C3=CC=CC=C3C4=C2C(=C(C(=C4SCCCCCC)SCCCCCC)SCCCCCC)SCCCCCC)SCCCCCC

Isomeric SMILES

CCCCCCSC1=C(C2=C(C=C1)C3=CC=CC=C3C4=C2C(=C(C(=C4SCCCCCC)SCCCCCC)SCCCCCC)SCCCCCC)SCCCCCC

InChI

InChI=1S/C54H84S6/c1-7-13-19-27-37-55-46-36-35-45-43-33-25-26-34-44(43)48-49(47(45)50(46)56-38-28-20-14-8-2)52(58-40-30-22-16-10-4)54(60-42-32-24-18-12-6)53(59-41-31-23-17-11-5)51(48)57-39-29-21-15-9-3/h25-26,33-36H,7-24,27-32,37-42H2,1-6H3